L-(-)-2,3-O-异亚丙基-酒石酸二甲酯 | 37031-29-1
中文名称:
L-(-)-2,3-O-异亚丙基-酒石酸二甲酯
英文名称:
dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
CAS No.:
37031-29-1
分子式:
C9 H1 4 O6
分子量:
218.2039
名称和标识符
MDL
MFCD00066218
InChIKey
ROZOUYVVWUTPNG-PHDIDXHHSA-N
Inchi
1S/C9H14O6/c1-9(2)14-5(7(10)12-3)6(15-9)8(11)13-4/h5-6H,1-4H3/t5-,6-/m1/s1
SMILES
O1[C@@]([H])(C(=O)OC([H])([H])[H])[C@]([H])(C(=O)OC([H])([H])[H])OC1(C([H])([H])[H])C([H])([H])[H]
别名信息
- 中文别名 -
L-(-)-2,3-O-异亚丙基-酒石酸二甲酯
(-)-2,3-O-异丙亚基-L-酒石酸二甲基酯
(-)-二甲基-2,3-邻异丙亚基-L-酒石酸酯
(4R,5r)-2,2-二甲基-1,3-二氧戊环-4,5-二羧酸二甲酯
(4R,5R)-2,2-二甲基-1,3-二氧戊环-4-羧酸甲酯
4R,5R-2,2-1,3-二氧戊环-4,5-二羧酸二甲酯
Dimethyl (-)-2,3-O-Isopropylidene-L-tartrate (-)-2,3-O-异丙亚基-L-酒石酸二甲基酯
(-)-2,3-O-异亚丙基-<small>L<
small>-酒石酸二甲酯
(-)-2,3-O-异亚丙基-L-酒石酸二甲酯
2,3-O-异亚丙基-L-酒石酸二甲酯
- 英文别名 -
(4R,5R)-Dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Dimethyl (-)-2,3-O-Isopropylidene-L-tartrate
(-)-Dimethyl 2,3-O-isopropylidene-L-tartrate
(?)-Dimethyl 2,3-O-isopropylidene-L-tartrate
(4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic Acid Dimethyl Ester
1,3-dioxolane-4,5-dicarboxylic acid, 2,2-dimethyl-, dimethyl ester, (4R,5R)-
dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
(-)-2,3-O-Isopropylidene-L-tartaric Acid Dimethyl Ester
(-)-Dimethyl-2,3-o-isopropylidene-l-tartrate
PubChem6766
CBDivE_005074
KSC917K0J
ROZOUYVVWUTPNG-PHDIDXHHSA-
4717AB
1,3-Dioxolane-4,5-dicarb
物化性质
实验特性
LogP
-0.14750
PSA
71.06
折射率
n20/D 1.439(lit.)
沸点
139°C/16mmHg(lit.)
熔点
40-43 ºC
闪点
华氏:230 °F 摄氏:110 °C
溶解度
略溶 (33 g/L) (25 ºC),
颜色与性状
液体
溶解性
不溶解的
光学活性
[α]20/D −54°, neat
密度
1.190 g/mL at 20 °C(lit.)
计算特性
精确分子量
218.07902
氢键供体数量
0
氢键受体数量
6
可旋转化学键数量
4
同位素质量
218.079
重原子数量
15
复杂度
246
同位素原子数量
0
确定原子立构中心数量
2
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
0.3
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
71.1
相关文献
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The journey of l-tartaric acid in the world of enantiomerically pure bis- and trisadducts of C60 with the inherently chiral trans-3 and all-trans-3 addition patterns
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2.
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参考资料
Reaxys RN
15406
Beilstein
19(3/4)3612